(4-nitrophenyl) 4H-pyrimidine-3-carboxylate

Systemtic Name: (4-nitrophenyl) 4H-pyrimidine-3-carboxylate Openeye Name: (4-nitrophenyl) 4H-pyrimidine-3-carboxylate CAS Name: 4H-pyrimidine-3-carboxylic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 4H-pyrimidine-3-carboxylate Traditional Name: 4H-pyrimidine-3-carboxylic acid (4-nitrophenyl) ester Formula: C11H9N3O4 MolecularWeight: 247.20686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C=CN=CN1C(=O)OC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1C=CN=CN1C(=O)OC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C11H9N3O4/c15-11(13-7-1-6-12-8-13)18-10-4-2-9(3-5-10)14(16)17/h1-6,8H,7H2